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(11S,16S)-misoprostol

CHEBI:CHEBI_63700

Definition

A methyl (13E)-11,16-dihydroxy-16-methyl-9-oxoprost-13-en-1-oate that has 8S,11S,12S,16S-configuration. It is a pharmacologically inactive diastereoisomeric component of misoprostol.

Chemical Information

Molecular Formula
C22H38O5
Molecular Mass
382.53410
Charge
0
SMILES
CCCC[C@](C)(O)C\C=C\[C@@H]1[C@@H](O)CC(=O)[C@H]1CCCCCCC(=O)OC
InChI
InChI=1S/C22H38O5/c1-4-5-14-22(2,26)15-10-12-18-17(19(23)16-20(18)24)11-8-6-7-9-13-21(25)27-3/h10,12,17-18,20,24,26H,4-9,11,13-16H2,1-3H3/b12-10+/t17-,18-,20-,22-/m0/s1
InChIKey
OJLOPKGSLYJEMD-MGUNLYMFSA-N

Alternative Names

  • methyl (8beta,11beta,12alpha,13E,16S)-11,16-dihydroxy-16-methyl-9-oxoprost-13-en-1-oate

Drug Classification

Important Medical Information

⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.

  • Always consult with a healthcare professional before starting, stopping, or modifying any medication.
  • Side effects may vary and this list may not be comprehensive.
  • Drug interactions may occur with other medications.

Additional Identifiers

core#notation
CHEBI:63700
oboInOwl#hasDbXref
Reaxys:7909810

Additional References

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Additional Attributes

oboInOwl#hasOBONamespace
chebi_ontology
oboInOwl#id
CHEBI:63700
core#notation
CHEBI:63700
oboInOwl#hasDbXref
Reaxys:7909810
oboInOwl#inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
chebi#is_enantiomer_of
http://purl.obolibrary.org/obo/CHEBI_63705
22-rdf-syntax-ns#type
http://www.w3.org/2002/07/owl#Class
BFO_0000051
http://purl.obolibrary.org/obo/CHEBI_63610
owl#someValuesFrom
t265530
owl#annotatedSource
t265616